Acetyl 3-Methylbutanoate

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Properties Simple | Detailed

Formula C7H12O3
IUPAC Name acetyl 3-methylbutanoate
Molecular Mass 144.168 g·mol−1
Heat of Formation -653.0 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 187.7 Å 3
Surface Area 189.99 Å 2
HOMO Energy -10.72 ± 0.55 eV
LUMO Energy 3.57 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methylbutanoic acid acetyl ester
  • 3-methylbutyric acid acetyl ester
  • ethanoyl 3-methylbutanoate
InChIKey VKXNTIHCBXRNTQ-UHFFFAOYSA-N
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Elements H C O